%chk=000260585.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260585

0 1
O 3.427870 0.002850 -1.442040
N 1.233995 0.000198 0.221167
N 2.513815 -0.000807 0.719646
N 4.842488 -0.000561 0.418190
N 5.985260 0.001307 -0.418366
C -1.138498 -0.000588 0.514661
C -1.796972 -1.221389 0.263364
C -1.795497 1.221346 0.265014
C -3.780462 0.001634 -0.433890
C -3.118477 -1.211929 -0.201194
C -3.117025 1.214080 -0.199540
C -1.089301 -2.519166 0.483504
C -1.086303 2.517984 0.486897
C -5.194940 0.002813 -0.918374
C 0.237820 -0.001919 1.059237
C 3.583511 0.000820 -0.251343
H -3.629861 -2.151721 -0.391022
H -3.627286 2.154743 -0.388085
H -0.739589 -2.619563 1.519160
H -1.718479 -3.390393 0.263625
H -0.202194 -2.588662 -0.168592
H -0.736008 2.616364 1.522549
H -0.199366 2.587468 -0.165459
H -1.714573 3.390264 0.268629
H -5.894542 0.002753 -0.069674
H -5.424931 0.885705 -1.529585
H -5.426051 -0.879055 -1.530637
H 0.289196 -0.004703 2.156366
H 2.697174 -0.003752 1.725334
H 4.950144 -0.000346 1.428364
H 6.553663 0.832256 -0.228595
H 6.554619 -0.829429 -0.230513


%chk=000260585-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260585

0 1
O 3.638410 1.890658 0.011024
N 1.344589 0.249956 0.231570
N 2.625271 -0.197489 0.500176
N 4.948907 0.049805 0.615742
N 6.172962 0.751507 0.528796
C -1.052201 -0.324673 0.173520
C -1.999046 -1.385527 0.399559
C -1.529059 0.960198 -0.269117
C -3.860777 0.106776 -0.246695
C -3.373923 -1.150888 0.184344
C -2.918514 1.138199 -0.467976
C -1.571243 -2.772888 0.863511
C -0.611309 2.135691 -0.537764
C -5.346680 0.346402 -0.442804
C 0.365591 -0.620484 0.408520
C 3.720804 0.681487 0.345811
H -4.084562 -1.969168 0.356281
H -3.273401 2.119168 -0.808600
H -1.066689 -2.748282 1.848553
H -2.452124 -3.428760 0.965011
H -0.880749 -3.260704 0.148932
H -0.017075 2.406045 0.352822
H 0.142368 1.900722 -1.310105
H -1.196954 3.013788 -0.861321
H -5.814455 0.725031 0.487362
H -5.535195 1.096309 -1.231200
H -5.874723 -0.583157 -0.719796
H 0.595326 -1.647549 0.754804
H 2.785018 -1.164663 0.825010
H 5.031558 -0.946449 0.821097
H 6.219549 1.497101 1.236582
H 6.307525 1.140440 -0.414848


